Glycine, N,N-bis(2-chloroethyl)-, ethyl ester, N-oxide, hydrochloride
TL;DR: Glycine, N,N-bis(2-chloroethyl)-, ethyl ester, N-oxide, hydrochloride (CAS 98551-71-4) is a chemical compound with molecular formula C8H15Cl3NO3- and molecular weight 278.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-bis(2-chloroethyl)-2-ethoxy-2-oxoethanamine oxide chloride
Also Known As: N,N-Bis(2-chloroethyl)glycine ethyl ester N-oxide hydrochloride, GLYCINE, N,N-BIS(2-CHLOROETHYL)-, ETHYL ESTER, N-OXIDE, HYDROCHLORIDE, N,N-bis(2-chloroethyl)-2-ethoxy-2-oxoethanamine oxide chloride, RefChem:1085988
| Molecular Formula | C8H15Cl3NO3- |
|---|---|
| Molecular Weight | 278.01 g/mol |
| LogP | -1.65 |
| Topological Polar Surface Area | 44.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 278.01175 |
| Heavy Atoms | 15 |
| Complexity | 172.0 |
Chemical Identifiers
| CAS Number | 98551-71-4 |
|---|---|
| SMILES | CCOC(=O)C[N+](CCCl)(CCCl)[O-].[Cl-] |
| InChIKey | CLVZVBARRGXKMN-UHFFFAOYSA-M |
Product Overview
Glycine, N,N-bis(2-chloroethyl)-, ethyl ester, N-oxide, hydrochloride (CAS 98551-71-4), with molecular formula C8H15Cl3NO3- and molecular weight 278.01 g/mol. IUPAC: N,N-bis(2-chloroethyl)-2-ethoxy-2-oxoethanamine oxide chloride.
Chemical Property Profile of Glycine, N,N-bis(2-chloroethyl)-, ethyl ester, N-oxide, hydrochloride
Property Insights of Glycine, N,N-bis(2-chloroethyl)-, ethyl ester, N-oxide, hydrochloride
The XLogP value of -1.65 indicates that Glycine, N,N-bis(2-chloroethyl)-, ethyl ester, N-oxide, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 44.4 Ų, Glycine, N,N-bis(2-chloroethyl)-, ethyl ester, N-oxide, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Glycine, N,N-bis(2-chloroethyl)-, ethyl ester, N-oxide, hydrochloride has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Glycine, N,N-bis(2-chloroethyl)-, ethyl ester, N-oxide, hydrochloride?
The CAS number of Glycine, N,N-bis(2-chloroethyl)-, ethyl ester, N-oxide, hydrochloride is 98551-71-4.
What is the molecular formula of Glycine, N,N-bis(2-chloroethyl)-, ethyl ester, N-oxide, hydrochloride?
The molecular formula of Glycine, N,N-bis(2-chloroethyl)-, ethyl ester, N-oxide, hydrochloride is C8H15Cl3NO3-.
What is the molecular weight of Glycine, N,N-bis(2-chloroethyl)-, ethyl ester, N-oxide, hydrochloride?
The molecular weight of Glycine, N,N-bis(2-chloroethyl)-, ethyl ester, N-oxide, hydrochloride is 278.01 g/mol.
Where can I buy Glycine, N,N-bis(2-chloroethyl)-, ethyl ester, N-oxide, hydrochloride?
You can request a quote for Glycine, N,N-bis(2-chloroethyl)-, ethyl ester, N-oxide, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Glycine, N,N-bis(2-chloroethyl)-, ethyl ester, N-oxide, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Glycine, N,N-bis(2-chloroethyl)-, ethyl ester, N-oxide, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.